Summary

Molecular formula: C30H26O12
SMILES: COc1c(O)c2C(=O)C=C(C(=O)c2c2c1C[C@](C)(O)[C@@H](c1c2c2C(=O)C(=CC(=O)c2c(c1OC)O)OC)C(=O)C)OC
InChI: InChI=1S/C30H26O12/c1-10(31)23-22-19(21-18(27(37)29(22)42-6)13(33)8-15(40-4)25(21)35)16-11(9-30(23,2)38)28(41-5)26(36)17-12(32)7-14(39-3)24(34)20(16)17/h7-8,23,36-38H,9H2,1-6H3/t23-,30+/m1/s1
InChIKey: UVHNWRDTZAYVST-DJUQAAIZSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1C=CC(=O)c2c1ccc1c2-c2c(ccc3c2C(=O)C=CC3=O)CCC1

Scaffold Graph/Node level:
OC1CCC(O)C2C1CCC1CCCC3CCC4C(O)CCC(O)C4C3C12

Scaffold Graph level:
CC1CCC(C)C2C1CCC1CCCC3CCC4C(C)CCC(C)C4C3C12

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Chemical classification

Kingdom: Organic compounds
Super class: Benzenoids
Class: Naphthalenes
Sub class: Naphthoquinones

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Synonymous chemical names:
hypocrellin d

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External chemical identifiers:
CID_12004204; NPATLAS_NPA012362; CHEMSPIDER_10176671; ZINC_ZINC000042805917

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Chemical structure download